2-methylsulfanyl-6-[2,2,2-tris(fluoranyl)ethanoylamino]pyrimidin-4-olate

Systemtic Name: 2-methylsulfanyl-6-[2,2,2-tris(fluoranyl)ethanoylamino]pyrimidin-4-olate Openeye Name: 2-methylsulfanyl-6-[(2,2,2-trifluoroacetyl)amino]pyrimidin-4-olate CAS Name: 2-(methylthio)-6-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-pyrimidinolate IUPAC Name: 2-methylsulfanyl-6-[(2,2,2-trifluoroacetyl)amino]pyrimidin-4-olate Traditional Name: 2-(methylthio)-6-[(2,2,2-trifluoroacetyl)amino]pyrimidin-4-olate Formula: C7H5F3N3O2S- MolecularWeight: 252.19371

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)[O-])NC(=O)C(F)(F)F

Isomeric SMILES

CSC1=NC(=CC(=N1)[O-])NC(=O)C(F)(F)F

InChI

InChI=1S/C7H6F3N3O2S/c1-16-6-12-3(2-4(14)13-6)11-5(15)7(8,9)10/h2H,1H3,(H2,11,12,13,14,15)/p-1